SCHEMBL435620

SCHEMBL435620

CCOC(=O)CP(=O)(O)O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.52
MGAM O43451 1/20 0.52
SI P14410 1/20 0.52
MGAM2 Q2M2H8 1/20 0.52
ALDH1A1 P00352 4/20 0.48
TRPA1 O75762 1/20 0.48
CYP2D6 P10635 1/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47
TSHR P16473 3/20 0.42
LMNA P02545 2/20 0.42
TDP1 Q9NUW8 2/20 0.42
MEN1 O00255 1/20 0.42
HPGD P15428 1/20 0.42
BLM P54132 1/20 0.42
KMT2A Q03164 1/20 0.42
HSD17B10 Q99714 1/20 0.42
CYP1A2 P05177 1/20 0.41
ALOX15 P16050 2/20 0.40
POLB P06746 1/20 0.40

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Hydrochloric Acid SCHEMBL6896809 0.98 GAA (0.50) GAAMGAMSIMGAM2ALDH1A1
Butane SCHEMBL945230 0.95 MGAM (0.48) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL6775118 0.95 GAA (0.48) GAAMGAMSIMGAM2ALDH1A1
Ethyl Acetate SCHEMBL28483432 0.91 ALDH1A1 (0.58) GAAMGAMSIMGAM2ALDH1A1
Diethylamine SCHEMBL27831367 0.89 GAA (0.48) GAAMGAMSIMGAM2ALDH1A1
Biphenyl SCHEMBL2044408 0.83 MEN1 (0.51) GAAALDH1A1TSHRLMNAMEN1
SCHEMBL6890644 0.81 GAA (0.48) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL1408938 0.81 ALDH1A1 (0.41) ALDH1A1CYP2D6CYP2C9CYP2C19TSHR
SCHEMBL11765179 0.80 GAA (0.52) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL2639544 0.79 MGAM (0.46) GAAMGAMSIMGAM2ALDH1A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 258 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025043316-A1 PROCESS FOR OBTAINING ANTI-INFLAMMATORY COMPOUNDS, SAID COMPOUNDS, PHARMACEUTICAL COMPOSITION AND USE OF SAID COMPOUNDS AND OF THE PHARMACEUTICAL COMPOSITION UNIVERSIDADE ESTADUAL DE CAMPINAS (BR) 2025-03-06 WO claimed
CN-117447355-A Preparation method of milbelin intermediate 南京威凯尔生物医药科技有限公司 2024-01-26 CN claimed
CN-104276979-B The preparation method of agomelatine intermediate body 江苏豪森药业集团有限公司 2018-09-07 CN claimed
CN-104276979-A Preparation method of agomelatine intermediate JIANGSU HANSOH PHARMACEUTICAL 2015-01-14 CN claimed
CN-101429125-B Synthesis of (7-methoxy-3, 4-dihydrogen-1-naphthyl) ethyl acetate SHANGHAI INST PHARM INDUSTRY 2012-03-07 CN claimed
CN-100532373-C Fully-synthesizing method for (2R,3S)-epoxy-9-(aprylene-1-OL GUANGZHOU CHEMISTRY INST CAS (CN) 2009-08-26 CN claimed
CN-101429125-A Synthesis of (7-methoxy-3, 4-dihydrogen-1-naphthyl) ethyl acetate SHANGHAI INST PHARM INDUSTRY (CN) 2009-05-13 CN claimed
CN-101070311-A Fully-synthesizing method for (2R,3S)-epoxy-9-(aprylene-1-OL GUANGZHOU CHEMISTRY INST CAS (CN) 2007-11-14 CN claimed
US-7193226-B2 Scratch resistant moisture-protecting parylene layers AGFA-GEVAERT (BE) 2007-03-20 US claimed
EP-0991689-B1 THREAD-FORMING, CHAIN-BRANCHED POLYESTERS AND COPOLYESTERS ACORDIS IND FIBERS GMBH (DE) 2003-11-26 EP claimed
EP-0102115-B1 POLYESTER-ESTER URETHANE AKZO N.V. (NL) 1987-06-10 EP claimed
US-4092412-A ADMINISTERING A CARBOXYLIC ESTER OF PHOSPHONOACETIC ACID ABBOTT LABORATORIES (US) 1978-05-30 US claimed
CN-109929096-B High-temperature-resistant modified copolyester 腾龙特种树脂(厦门)有限公司 2024-05-28 CN disclosed
WO-2024076873-A1 HETEROCYCLIC INHIBITORS OF CD73 FOR TREATMENT OF DISEASE TEON THERAPEUTICS, INC. (US) 2024-04-11 WO disclosed
CN-114214375-B Process for the preparation of (R) -3- (4-halo-1H-pyrazol-1-yl) -3-cyclopentylpropionate 江苏威凯尔医药科技有限公司 2024-03-19 CN disclosed
WO-2023176837-A1 CERAMIC CONTINUOUS FIBER AND METHOD FOR PRODUCING SAME, AND CERAMIC MATRIX COMPOSITE MATERIAL INCLUDING SAME 東ソー株式会社 2023-09-21 WO disclosed
US-4093651-A CATALYTIC REACTION OF CHLORINE AND CARBON DISULFIDE IN PRESENCE OF PHOSPHONATES OR PHOSPHONITES STAUFFER CHEMICAL COMPANY (US) 1978-06-06 US disclosed
US-4092412-A ADMINISTERING A CARBOXYLIC ESTER OF PHOSPHONOACETIC ACID ABBOTT LABORATORIES (US) 1978-05-30 US disclosed
US-4086334-A A CALCITONIN AND AN ADJUVANT CONTAINING CARBOXY AND/OR PHOSPHONO GROUPS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DT) 1978-04-25 US disclosed
US-4056673-A VIRICIDE, ANTINEOPLASTIC HOFFMANN-LA ROCHE INC. (US) 1977-11-01 US disclosed